3,5-dimethoxy-N-[(2S)-3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide
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![3,5-dimethoxy-N-[(2S)-3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b20ebf8351e94a3f9abf511fba3387f5.png "3,5-dimethoxy-N-[(2S)-3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide")
3,5-dimethoxy-N-[(2S)-3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide
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CAS No:
956042-50-5
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Formula:
C22H25N3O4S
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Chemical Name:
3,5-dimethoxy-N-[(2S)-3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide
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Synonyms:
ZINC2623602;AKOS034827274;MCULE-7322041478;AB00725927-01;Z57005036;(2S)-2-[(3,5-dimethoxyphenyl)formamido]-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide;956042-50-5
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CAS No:
3,5-dimethoxy-N-[(2S)-3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide Basic Attributes
427.5 g/mol
427.15657746 g/mol
Computed Properties
Molecular Weight:427.5
XLogP3:4.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:427.15657746
Monoisotopic Mass:427.15657746
Topological Polar Surface Area:118
Heavy Atom Count:30
Complexity:593
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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